N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine

C182H124N6Si2 — CID 158527039

About N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine

N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine (PubChem CID 158527039) has the molecular formula C182H124N6Si2 and a molecular weight of 2451.21 g/mol. Its IUPAC name is N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine.

Molecular Properties

• Compound Name: N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine
• PubChem CID: 158527039
• Molecular Formula: C182H124N6Si2
• Molecular Weight: 2451.21 g/mol
• Exact Mass: 2448.94
• IUPAC Name: N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine
• SMILES: c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)cc4)c4ccc5c6cccc7c8ccccc8n(c5c4)c76)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)cc4)cc3)c3ccc4c5cccc6c7ccccc7n(c4c3)c65)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(ccc6ccccc65)c4)cc3)c3ccc4c5cccc6c7ccccc7n(c4c3)c65)cc2)cc1
• InChI: InChI=1S/2C66H46N2Si.C50H32N2/c1-5-16-47(17-6-1)50-32-38-53(39-33-50)67(55-42-45-61-63-26-15-25-62-60-24-13-14-27-64(60)68(66(62)63)65(61)46-55)54-40-34-51(35-41-54)48-28-30-49(31-29-48)52-36-43-59(44-37-52)69(56-18-7-2-8-19-56,57-20-9-3-10-21-57)58-22-11-4-12-23-58;1-5-16-47(17-6-1)48-28-30-49(31-29-48)50-32-38-53(39-33-50)67(55-42-45-61-63-26-15-25-62-60-24-13-14-27-64(60)68(66(62)63)65(61)46-55)54-40-34-51(35-41-54)52-36-43-59(44-37-52)69(56-18-7-2-8-19-56,57-20-9-3-10-21-57)58-22-11-4-12-23-58;1-2-9-33(10-3-1)34-19-24-39(25-20-34)51(40-26-21-35(22-27-40)37-23-29-43-38(31-37)18-17-36-11-4-5-12-42(36)43)41-28-30-45-47-15-8-14-46-44-13-6-7-16-48(44)52(50(46)47)49(45)32-41/h2*1-46H;1-32H
• InChIKey: HMXGYHAAFIFPCX-UHFFFAOYSA-N
• XLogP: 43.32
• TPSA: 22.95 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 25
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2451.21
LogP ≤ 5	43.32
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine?

The IUPAC name of N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine (CID 158527039) is N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine.

What is the SMILES notation for N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine?

The canonical SMILES for N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)cc4)c4ccc5c6cccc7c8ccccc8n(c5c4)c76)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)cc4)cc3)c3ccc4c5cccc6c7ccccc7n(c4c3)c65)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5c(ccc6ccccc65)c4)cc3)c3ccc4c5cccc6c7ccccc7n(c4c3)c65)cc2)cc1.

What is the InChIKey of N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine?

The InChIKey is HMXGYHAAFIFPCX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C66H46N2Si.C50H32N2/c1-5-16-47(17-6-1)50-32-38-53(39-33-50)67(55-42-45-61-63-26-15-25-62-60-24-13-14-27-64(60)68(66(62)63)65(61)46-55)54-40-34-51(35-41-54)48-28-30-49(31-29-48)52-36-43-59(44-37-52)69(56-18-7-2-8-19-56,57-20-9-3-10-21-57)58-22-11-4-12-23-58;1-5-16-47(17-6-1)48-28-30-49(31-29-48)50-32-38-53(39-33-50)67(55-42-45-61-63-26-15-25-62-60-24-13-14-27-64(60)68(66(62)63)65(61)46-55)54-40-34-51(35-41-54)52-36-43-59(44-37-52)69(56-18-7-2-8-19-56,57-20-9-3-10-21-57)58-22-11-4-12-23-58;1-2-9-33(10-3-1)34-19-24-39(25-20-34)51(40-26-21-35(22-27-40)37-23-29-43-38(31-37)18-17-36-11-4-5-12-42(36)43)41-28-30-45-47-15-8-14-46-44-13-6-7-16-48(44)52(50(46)47)49(45)32-41/h2*1-46H;1-32H.

What are the key properties of N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine?

N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine has a molecular weight of 2451.21 g/mol, XLogP of 43.32, 25 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-phenanthren-2-ylphenyl)-N-(4-phenylphenyl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-[4-(4-triphenylsilylphenyl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine;N-(4-phenylphenyl)-N-[4-[4-(4-triphenylsilylphenyl)phenyl]phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-amine is sourced from PubChem (CID 158527039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).